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Compile Data Set for Download or QSAR

Found 4 hits of ic50 for monomerid = 50483699   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Reverse transcriptase


(Human immunodeficiency virus 1)
BDBM50483699
PNG
(CHEMBL1766226)
Show SMILES Cc1cc(C)cc(c1)S(=O)(=O)c1c([nH]c2ccc(Br)cc12)C(=O)NCCN1CCCC1
Show InChI InChI=1S/C23H26BrN3O3S/c1-15-11-16(2)13-18(12-15)31(29,30)22-19-14-17(24)5-6-20(19)26-21(22)23(28)25-7-10-27-8-3-4-9-27/h5-6,11-14,26H,3-4,7-10H2,1-2H3,(H,25,28)
PDB
MMDB

UniProtKB/TrEMBL

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 65n/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Inhibition of HIV1 wild type reverse transcriptase expressed in Escherichia coli assessed as incorporation of [3H]dTTP into poly(rA)/oligo(dT) by sci...


J Med Chem 54: 1587-98 (2011)


Article DOI: 10.1021/jm101614j
BindingDB Entry DOI: 10.7270/Q2ZG6W3H
More data for this
Ligand-Target Pair
Reverse transcriptase protein


(Human immunodeficiency virus 1)
BDBM50483699
PNG
(CHEMBL1766226)
Show SMILES Cc1cc(C)cc(c1)S(=O)(=O)c1c([nH]c2ccc(Br)cc12)C(=O)NCCN1CCCC1
Show InChI InChI=1S/C23H26BrN3O3S/c1-15-11-16(2)13-18(12-15)31(29,30)22-19-14-17(24)5-6-20(19)26-21(22)23(28)25-7-10-27-8-3-4-9-27/h5-6,11-14,26H,3-4,7-10H2,1-2H3,(H,25,28)
PDB
MMDB

UniProtKB/TrEMBL

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 315n/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Inhibition of HIV1 reverse transcriptase L100I mutant expressed in Escherichia coli assessed as incorporation of [3H]dTTP into poly(rA)/oligo(dT) by ...


J Med Chem 54: 1587-98 (2011)


Article DOI: 10.1021/jm101614j
BindingDB Entry DOI: 10.7270/Q2ZG6W3H
More data for this
Ligand-Target Pair
Reverse transcriptase protein


(Human immunodeficiency virus 1)
BDBM50483699
PNG
(CHEMBL1766226)
Show SMILES Cc1cc(C)cc(c1)S(=O)(=O)c1c([nH]c2ccc(Br)cc12)C(=O)NCCN1CCCC1
Show InChI InChI=1S/C23H26BrN3O3S/c1-15-11-16(2)13-18(12-15)31(29,30)22-19-14-17(24)5-6-20(19)26-21(22)23(28)25-7-10-27-8-3-4-9-27/h5-6,11-14,26H,3-4,7-10H2,1-2H3,(H,25,28)
PDB
MMDB

UniProtKB/TrEMBL

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 697n/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Inhibition of HIV1 reverse transcriptase K103N mutant expressed in Escherichia coli assessed as incorporation of [3H]dTTP into poly(rA)/oligo(dT) by ...


J Med Chem 54: 1587-98 (2011)


Article DOI: 10.1021/jm101614j
BindingDB Entry DOI: 10.7270/Q2ZG6W3H
More data for this
Ligand-Target Pair
Reverse transcriptase


(Human immunodeficiency virus 1)
BDBM50483699
PNG
(CHEMBL1766226)
Show SMILES Cc1cc(C)cc(c1)S(=O)(=O)c1c([nH]c2ccc(Br)cc12)C(=O)NCCN1CCCC1
Show InChI InChI=1S/C23H26BrN3O3S/c1-15-11-16(2)13-18(12-15)31(29,30)22-19-14-17(24)5-6-20(19)26-21(22)23(28)25-7-10-27-8-3-4-9-27/h5-6,11-14,26H,3-4,7-10H2,1-2H3,(H,25,28)
PDB
MMDB

UniProtKB/TrEMBL

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a>4.00E+4n/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Inhibition of HIV1 reverse transcriptase Y181I mutant expressed in Escherichia coli assessed as incorporation of [3H]dTTP into poly(rA)/oligo(dT) by ...


J Med Chem 54: 1587-98 (2011)


Article DOI: 10.1021/jm101614j
BindingDB Entry DOI: 10.7270/Q2ZG6W3H
More data for this
Ligand-Target Pair